V002-1704 Screening compound: bis(3-fluorophenyl)[5-({[(3-methoxyphenyl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]methanol

V002-1704 Screening compound: bis(3-fluorophenyl)[5-({[(3-methoxyphenyl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]methanol
V002-1704 Screening compound: bis(3-fluorophenyl)[5-({[(3-methoxyphenyl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-1704
bis(3-fluorophenyl)[5-({[(3-methoxyphenyl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]methanol

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V002-1704

Molecular Formula

C31H31F2NO4 (C31 H31 F2 NO4)

Compound Name

bis(3-fluorophenyl)[5-({[(3-methoxyphenyl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]methanol

IUPAC name

bis(3-fluorophenyl)[5-({[(3-methoxyphenyl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]methanol

SMILES

COc1cccc(CN(CC2OCCC2)Cc2ccc(C(c3cc(F)ccc3)(c3cccc(F)c3)O)o2)c1

InChI

InChI=1S/C31H31F2NO4/c1-36-27-11-2-6-22(16-27)19-34(20-28-12-5-15-37-28)21-29-13-14-30(38-29)31(35,23-7-3-9-25(32)17-23)24-8-4-10-26(33)18-24/h2-4,6-11,13-14,16-18,28,35H,5,12,15,19-21H2,1H3/t28-/m1/s1

InChI Key

VHZDZGPTBFWAKH-MUUNZHRXSA-N

MDL Number (MFCD)

MFCD19872786

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

519.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.099

Distribution Coefficient, logD

5.413

Water Solubility, LogSw

-5.50

Polar Surface Area

42.243

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.00

V002-1704 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V002-1704 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-1704?
Check Price and Availability of V002-1704, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V002-1704 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-1704
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-1704
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V002-1704 available by request